Geometry & MOs

Info

ID:	217942
PubChem CID:	85088627
Reduced:	NS2O3C22H23 (1)
Stoich.:	AB2C3D22E23 (1)
Weight, g/mol:	413.202235
ΔH_f, kcal/mol:	-51.48
Dipole, Da:	6.46
IP(EA), eV:	-8.59(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[tert-butyl(dimethyl)silyl]oxy-phenylmethyl]-3-hydroxy-1-(4-methoxyphenyl)azetidin-2-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC(CSC2=CC=C(C=C2)OC)C3=CC=CC=C3

DOS

IR

Vibrations